CID 22018666

8-methylidene-5,6,7,8-tetrahydroquinoline

Structural Information

Molecular Formula

C₁₀H₁₁N

SMILES

C=C1CCCC2=C1N=CC=C2

InChI

InChI=1S/C10H11N/c1-8-4-2-5-9-6-3-7-11-10(8)9/h3,6-7H,1-2,4-5H2

InChIKey

LFHOFRHETFNXQB-UHFFFAOYSA-N

Compound name

8-methylidene-6,7-dihydro-5H-quinoline

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 42
Patents: 145.08914 Da
Monoisotopic Mass: 2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	146.09642	128.5
[M+Na]+	168.07836	136.1
[M-H]-	144.08186	131.3
[M+NH4]+	163.12296	149.6
[M+K]+	184.05230	132.9
[M+H-H2O]+	128.08640	122.0
[M+HCOO]-	190.08734	148.7
[M+CH3COO]-	204.10299	141.8
[M+Na-2H]-	166.06381	136.8
[M]+	145.08859	124.8
[M]-	145.08969	124.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe